ethyl N-{4-[6-(3-ethoxy-3-oxopropyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine-1-carbonyl}phenylalaninate
Chemical Structure Depiction of
ethyl N-{4-[6-(3-ethoxy-3-oxopropyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine-1-carbonyl}phenylalaninate
ethyl N-{4-[6-(3-ethoxy-3-oxopropyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine-1-carbonyl}phenylalaninate
Compound characteristics
| Compound ID: | V002-8580 |
| Compound Name: | ethyl N-{4-[6-(3-ethoxy-3-oxopropyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazine-1-carbonyl}phenylalaninate |
| Molecular Weight: | 537.62 |
| Molecular Formula: | C27 H35 N7 O5 |
| Salt: | not_available |
| Smiles: | CCOC(CCc1c(C)nc2ncnn2c1N1CCN(CC1)C(NC(Cc1ccccc1)C(=O)OCC)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.9978 |
| logD: | 2.9684 |
| logSw: | -3.2635 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.717 |
| InChI Key: | XZOUAKBACKFITR-QFIPXVFZSA-N |